SCHEMBL19524136

SCHEMBL19524136

O=Cc1ccc(O)cc1Oc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 5/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
CTSL P07711 2/20 0.45
CTSB P07858 1/20 0.45
TRIM24 O15164 1/20 0.44
TYR P14679 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
NPSR1 Q6W5P4 1/20 0.41
ESR1 P03372 3/20 0.40
CAMK2A Q9UQM7 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
MAP2K1 Q02750 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6142665 0.86 LMNA (0.52) LMNAGAAKMT2AALDH1A1CYP1A2
SCHEMBL19524123 0.81 ERN1 (0.41) KMT2AALDH1A1CTSLCTSB
SCHEMBL5991889 0.81 LMNA (0.46) LMNAGAAKMT2AALDH1A1CYP1A2
SCHEMBL28356776 0.80 TYR (0.59) LMNAGAAKMT2AALDH1A1TRIM24
SCHEMBL19524197 0.79 ERN1 (0.42) ALDH1A1CTSLCTSBTRIM24TYR
SCHEMBL19524209 0.79 TTR (0.43) LMNACTSLCTSBCAMK2AMAPT
SCHEMBL5988928 0.78 SCN8A (0.45) LMNAGAAKMT2AALDH1A1CYP1A2
SCHEMBL19524117 0.78 ERN1 (0.50) KMT2AALDH1A1CTSLCTSBTRIM24
SCHEMBL1201051 0.78 LMNA (0.75) LMNAGAAKMT2AALDH1A1CYP1A2
SCHEMBL18570705 0.77 SCN8A (0.46) LMNAGAAKMT2AALDH1A1CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3239134-A1 PYRIDONE AMIDES AS MODULATORS OF SODIUM CHANNELS Vertex Pharmaceuticals Incorporated (US) 2017-11-01 EP disclosed